Receptor
PDB id Resolution Class Description Source Keywords
1VL8 2.07 Å EC: 1.1.1.69 CRYSTAL STRUCTURE OF GLUCONATE 5-DEHYDROGENASE (TM0441) FROM THERMOTOGA MARITIMA AT 2.07 A RESOLUTION THERMOTOGA MARITIMA TM0441 GLUCONATE 5-DEHYDROGENASE STRUCTURAL GENOMICS JCSGSTRUCTURE INITIATIVE PSI JOINT CENTER FOR STRUCTURAL GENOOXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF GLUCONATE 5-DEHYDROGENASE (TM0 THERMOTOGA MARITIMA AT 2.07 A RESOLUTION TO BE PUBLISHED
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG B:256;
Part of Protein;
none;
submit data
24.305 Mg [Mg+2...
NAP A:274;
B:274;
Valid;
Valid;
none;
none;
submit data
743.405 C21 H28 N7 O17 P3 c1cc(...
PO4 A:256;
Invalid;
none;
submit data
94.971 O4 P [O-]P...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1VL8 2.07 Å EC: 1.1.1.69 CRYSTAL STRUCTURE OF GLUCONATE 5-DEHYDROGENASE (TM0441) FROM THERMOTOGA MARITIMA AT 2.07 A RESOLUTION THERMOTOGA MARITIMA TM0441 GLUCONATE 5-DEHYDROGENASE STRUCTURAL GENOMICS JCSGSTRUCTURE INITIATIVE PSI JOINT CENTER FOR STRUCTURAL GENOOXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF GLUCONATE 5-DEHYDROGENASE (TM0 THERMOTOGA MARITIMA AT 2.07 A RESOLUTION TO BE PUBLISHED
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1VL8 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1VL8 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
50% Homology Family (89)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 177 families.
1 1E6W - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 1VL8 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
3 3A28 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
4 1X7G - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
5 2RH4 Ki = 15 uM EMO C15 H10 O5 Cc1cc2c(c(....
6 2RHR - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
7 3RI3 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
8 2RHC - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
9 1Q7B Kd = 3.5 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
10 1Q7C - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
11 1GEG - GLC C6 H12 O6 C([C@@H]1[....
12 3VZS - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
13 4N5N - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
14 4QEC - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
15 4QED - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
16 3AY6 - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
17 3AUU - BGC C6 H12 O6 C([C@@H]1[....
18 3AUT - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
19 4BNT ic50 = 137.69 uM 36E C8 H5 F3 N2 c1ccc2c(c1....
20 4BNY ic50 = 0.08 uM 36I C16 H15 N3 O S c1ccc(cc1)....
21 4BNV ic50 = 0.03 uM Q7U C15 H13 Cl N4 O Cn1c2ccccc....
22 4BO1 ic50 = 0.05 uM NKH C18 H15 Cl N2 O3 COc1cc(c(c....
23 4AG3 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
24 4BO2 ic50 = 0.05 uM 36K C17 H18 N4 O2 CCn1c2cccc....
25 4BNX ic50 = 0.02 uM O74 C20 H14 Cl N3 O c1ccc2c(c1....
26 4BNU ic50 = 0.02 uM 9KQ C16 H11 N5 c1ccc(cc1)....
27 4BO3 ic50 = 0.3 uM U98 C12 H10 F3 N3 O2 S c1cc(cc(c1....
28 4NBT - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
29 1H5Q - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
30 1IPE - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
31 1IPF - TNE C8 H13 N O CN1[C@H]2C....
32 1U7T Ki = 425 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
33 1NFF - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
34 1NFR - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
35 1XKQ - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
36 2ZAT - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
37 1O5I - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
38 2ZTL - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
39 2ZTU - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
40 2ZTM - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
41 5EN4 Ki = 64 nM 5Q6 C18 H12 F N O4 c1cc(c(c(c....
42 5L7T Ki = 26 nM 6QJ C19 H14 F N O3 Cc1cc(ccc1....
43 5L7W Ki = 11 nM 6QU C18 H11 F2 N O4 c1cc(c(c(c....
44 5ICM - GLC C6 H12 O6 C([C@@H]1[....
45 5JS6 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
46 5JSF - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
47 1ZK4 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
48 1ZK0 - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
49 1ZJZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
50 1ZJY - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
51 3LQF - MRY C4 H10 O4 C([C@H]([C....
52 2WDZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
53 4NBW - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
54 1DOH Ki = 2.4 nM NID C9 H5 N O3 c1cc2c(c(c....
55 4GH5 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
56 1CYD - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
57 1RWB - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
58 1G6K - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
59 1GEE - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
60 5EPO - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
61 4URE - 1PS C8 H11 N O3 S c1cc[n+](c....
62 4URF - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
63 4KWI - 1TJ C19 H12 O5 Cc1cc2c(c(....
64 4FN4 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
65 2CFC - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
66 3ICC - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
67 1UAY - ADN C10 H13 N5 O4 c1nc(c2c(n....
68 2B4Q - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
69 1IY8 Ki = 23.8 mM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
70 4CR7 - MAN C6 H12 O6 C([C@@H]1[....
71 5ITV - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
72 1AHI - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
73 1FMC - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
74 5B4T - 3HR C4 H8 O3 C[C@H](CC(....
75 5FFF ic50 = 425 uM 5XC C8 H6 O3 c1cc2c(cc1....
76 3O03 - GCO C6 H12 O7 C([C@H]([C....
77 2DTX - BMA C6 H12 O6 C([C@@H]1[....
78 5FEU - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
79 2AG5 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
80 1JA9 Ki = 420 nM PYQ C11 H11 N O c1cc2c3c(c....
81 1AE1 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
82 1PR9 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
83 1WNT - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
84 2BGM - NAJ C21 H27 N7 O14 P2 c1cc(c[n+]....
85 2GDZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
86 1UZN Kd = 11.2 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
87 1HDC Ki = 1 uM CBO C34 H50 O7 CC1([C@@H]....
88 3QWI ic50 = 2.8 uM CUE C15 H8 O5 c1cc2c(cc1....
89 1XHL - TNE C8 H13 N O CN1[C@H]2C....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NAP; Similar ligands found: 127
No: Ligand ECFP6 Tc MDL keys Tc
1 NAP 1 1
2 NA0 0.881356 0.986301
3 TAP 0.872881 0.934211
4 NDO 0.840336 0.972603
5 NAD 0.811966 0.986111
6 N01 0.733871 0.958904
7 A3D 0.712 0.972603
8 NBP 0.707692 0.935065
9 NAD IBO 0.688 0.921053
10 NHD 0.68254 0.958904
11 NJP 0.661417 0.972973
12 NAJ PYZ 0.659091 0.898734
13 NFD 0.658915 0.934211
14 DND 0.619048 0.959459
15 NXX 0.619048 0.959459
16 ZID 0.605839 0.972603
17 NAQ 0.59854 0.922078
18 ATR 0.59292 0.917808
19 NAE 0.591241 0.946667
20 NDE 0.58042 0.986301
21 A22 0.571429 0.958904
22 AMP NAD 0.571429 0.933333
23 NAJ 0.567164 0.986111
24 A2R 0.563025 0.932432
25 NDC 0.561644 0.922078
26 NA7 0.552846 0.907895
27 ODP 0.551471 0.935065
28 A2P 0.539823 0.930556
29 8ID 0.537313 0.910256
30 NAD BBN 0.525974 0.865854
31 NPW 0.525547 0.8875
32 CNA 0.521739 0.959459
33 NZQ 0.521739 0.910256
34 NAD CJ3 0.519231 0.835294
35 NDP 0.514493 0.922078
36 PO4 PO4 A A A A PO4 0.503937 0.930556
37 DG1 0.503401 0.922078
38 1DG 0.503401 0.922078
39 NAD TDB 0.5 0.696078
40 TXP 0.5 0.922078
41 NMN AMP PO4 0.492958 0.921053
42 XNP 0.492958 0.875
43 25L 0.492308 0.958904
44 25A 0.492063 0.972222
45 NAD NDT 0.490909 0.747368
46 NMN 0.486726 0.888889
47 NGD 0.485714 0.935065
48 2AM 0.477876 0.891892
49 ADP 0.458333 0.945205
50 PAP 0.451613 0.931507
51 ADP MG 0.45082 0.906667
52 BEF ADP 0.447154 0.883117
53 ADP BEF 0.447154 0.883117
54 A2D 0.445378 0.945205
55 AN2 0.442623 0.932432
56 ADP PO3 0.44 0.944444
57 SAP 0.44 0.896104
58 AGS 0.44 0.896104
59 M33 0.439024 0.906667
60 AR6 AR6 0.438849 0.945205
61 BA3 0.438017 0.945205
62 ATP MG 0.436508 0.906667
63 ADP BMA 0.43609 0.92
64 OAD 0.43609 0.92
65 ATP 0.435484 0.945205
66 OOB 0.435115 0.958904
67 B4P 0.434426 0.945205
68 AP5 0.434426 0.945205
69 GAP 0.433071 0.92
70 0WD 0.432432 0.922078
71 5FA 0.432 0.945205
72 2A5 0.432 0.87013
73 AQP 0.432 0.945205
74 00A 0.428571 0.909091
75 CA0 0.427419 0.92
76 ALF ADP 0.426357 0.871795
77 ADP ALF 0.426357 0.871795
78 ACP 0.424 0.92
79 NAJ PZO 0.423841 0.897436
80 9SN 0.423358 0.897436
81 VO4 ADP 0.423077 0.932432
82 ANP MG 0.423077 0.896104
83 ADP VO4 0.423077 0.932432
84 WAQ 0.422222 0.884615
85 ACQ 0.421875 0.92
86 V3L 0.421875 0.945205
87 ADQ 0.421053 0.92
88 AR6 0.420635 0.918919
89 APR 0.420635 0.918919
90 ATP A A A 0.42029 0.958333
91 CO7 0.419753 0.786517
92 1ZZ 0.419118 0.841463
93 3OD 0.419118 0.92
94 DLL 0.41791 0.958904
95 AD9 0.417323 0.92
96 NAX 0.416667 0.875
97 OVE 0.416667 0.857143
98 MYR AMP 0.416058 0.841463
99 AV2 0.415385 0.868421
100 A3P 0.414634 0.944444
101 NNR 0.414414 0.72973
102 ALF ADP 3PG 0.413793 0.8625
103 OMR 0.413793 0.831325
104 LA8 ALF 3PG 0.413793 0.8625
105 ANP 0.410853 0.92
106 A1R 0.410448 0.860759
107 ABM 0.409836 0.893333
108 AMP 0.408333 0.944444
109 A 0.408333 0.944444
110 SON 0.408 0.933333
111 PPS 0.407692 0.829268
112 5AL 0.407692 0.932432
113 TYR AMP 0.407143 0.933333
114 NAI 0.406897 0.909091
115 7D3 0.406504 0.857143
116 DAL AMP 0.406015 0.932432
117 ADX 0.404762 0.829268
118 ATF 0.40458 0.907895
119 3UK 0.404412 0.945946
120 AMP DBH 0.404255 0.894737
121 139 0.402685 0.875
122 AMP MG 0.401639 0.893333
123 50T 0.401575 0.906667
124 SRP 0.401515 0.907895
125 A A 0.40146 0.972222
126 FA5 0.4 0.933333
127 3AM 0.4 0.90411
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1VL8; Ligand: NAP; Similar sites found: 430
This union binding pocket(no: 1) in the query (biounit: 1vl8.bio1) has 34 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5T9F TYR 0.0002537 0.44327 None
2 5T9F NAP 0.0003746 0.43574 None
3 5T9E NAP 0.0003926 0.41581 None
4 5F5N NAD 0.000002469 0.48764 0.749064
5 4GKV NAD 0.0001197 0.45121 1.1236
6 1GV0 NAD 0.0001155 0.44052 1.49813
7 1GUZ NAD 0.0001591 0.43139 1.49813
8 5ULP KB1 0.0004695 0.40319 1.49813
9 4JK3 NAD 0.000812 0.40393 1.9305
10 1T26 NAI 0.0002623 0.4487 2.17391
11 1GY8 NAD 0.0000000815 0.55557 2.24719
12 2V6G NAP 0.0000006131 0.52593 2.24719
13 2EXX NAP 0.00003397 0.47119 2.24719
14 3VPH NAD 0.00008922 0.45439 2.24719
15 2F1K NAP 0.00002532 0.45327 2.24719
16 1EZ4 NAD 0.00002384 0.45132 2.24719
17 3VPH OXM 0.0001572 0.44828 2.24719
18 5MDH NAD 0.0002161 0.42235 2.24719
19 4MDH NAD 0.000241 0.42128 2.24719
20 1GAD NAD 0.0002382 0.42077 2.24719
21 1WP4 NDP 0.0003151 0.42029 2.24719
22 2GCG NDP 0.0005151 0.41513 2.24719
23 4DPL NAP 0.0006967 0.41434 2.24719
24 1U8X NAD 0.003863 0.40953 2.24719
25 3OA2 NAD 0.0008154 0.40695 2.24719
26 2CVZ NDP 0.0006839 0.40609 2.24719
27 4J4H NAI 0.003852 0.40836 2.3166
28 4J4H 1J1 0.003852 0.40836 2.3166
29 2Q46 NAP 0.0000001114 0.54405 2.37154
30 1HDO NAP 0.000002911 0.51017 2.42718
31 3NJ4 AFX 0.01519 0.41577 2.52874
32 3NJ4 NAD 0.0165 0.41423 2.52874
33 1N7G NDP 0.0000003938 0.58384 2.62172
34 1N7G GDR 0.0000004 0.57083 2.62172
35 1RPN NDP 0.0000001227 0.56417 2.62172
36 1HDG NAD 0.0001483 0.47012 2.62172
37 2GZ3 NAP 0.0003862 0.44855 2.62172
38 4XQC NAD 0.0003358 0.44575 2.62172
39 1LDN NAD 0.0001067 0.44539 2.62172
40 4XQC 13D 0.0005195 0.43962 2.62172
41 3B1F NAD 0.00003898 0.4299 2.62172
42 2V6O FAD 0.003587 0.42618 2.62172
43 1NVM NAD 0.00066 0.41751 2.62172
44 4DMG SAM 0.02006 0.4115 2.62172
45 1KEV NDP 0.002685 0.40183 2.62172
46 4XYB NDP 0.001263 0.41381 2.8133
47 1SB8 UD2 0.00000004813 0.60291 2.99625
48 1SB8 NAD 0.00000007544 0.58983 2.99625
49 1RKX NAD 0.00000001485 0.58243 2.99625
50 1CER NAD 0.00005728 0.48295 2.99625
51 2A92 NAI 0.0002275 0.43673 2.99625
52 5JY6 NAD 0.001249 0.42982 2.99625
53 2I3G NAP 0.0003746 0.42655 2.99625
54 1U1I NAD 0.0006182 0.42515 2.99625
55 3H9E NAD 0.0001925 0.42449 2.99625
56 2VHW NAI 0.000939 0.42102 2.99625
57 2VYN NAD 0.0005351 0.41546 2.99625
58 2V3A FAD 0.001698 0.41383 2.99625
59 4R5M NAP 0.0005929 0.41335 2.99625
60 4R5M 4NO 0.0008646 0.41317 2.99625
61 1FEC FAD 0.004342 0.40636 2.99625
62 2RAB FAD 0.003914 0.40628 2.99625
63 1GTE FAD 0.007736 0.40581 2.99625
64 4OPC PGT 0.02283 0.40517 2.99625
65 4OPC FDA 0.01981 0.40497 2.99625
66 2NU8 COA 0.000821 0.40155 2.99625
67 2A8X FAD 0.005323 0.40028 2.99625
68 2PZM NAD 0.000002726 0.52488 3.0303
69 2PZM UDP 0.000002726 0.52488 3.0303
70 2CVQ NDP 0.0008658 0.40697 3.0581
71 3MB5 SAM 0.0004247 0.40148 3.13725
72 3CMC NAD 0.001245 0.44085 3.37079
73 2JHF NAD 0.00604 0.43743 3.37079
74 1GR0 NAD 0.0007474 0.42214 3.37079
75 1PL6 572 0.0007224 0.41856 3.37079
76 1I8T FAD 0.001509 0.41685 3.37079
77 2NVK FAD 0.00209 0.41367 3.37079
78 4BVA T3 0.002419 0.40811 3.37079
79 1PL6 NAD 0.0001621 0.40561 3.37079
80 5JWC FAD 0.002387 0.40491 3.37079
81 4BVA NDP 0.001506 0.40491 3.37079
82 1TB4 PEJ 0.001536 0.40138 3.37079
83 5A04 NDP 0.007597 0.40031 3.37079
84 5A04 BGC 0.008316 0.40031 3.37079
85 3CGD FAD 0.01134 0.40801 3.54167
86 3CGD NAD 0.01134 0.40801 3.54167
87 3CGD COA 0.01134 0.40801 3.54167
88 3CGB FAD 0.002567 0.40605 3.54167
89 1UXG NAD 0.00008701 0.46179 3.55987
90 1X87 NAD 0.0005081 0.40227 3.62976
91 1E7S NAP 0.00000005075 0.56794 3.74532
92 2YY7 NAD 0.000000133 0.54912 3.74532
93 3I6I NDP 0.0001069 0.45847 3.74532
94 4PLG NAI 0.0001177 0.45561 3.74532
95 2HJR APR 0.00001532 0.44526 3.74532
96 4RSL FAD 0.0006173 0.42774 3.74532
97 3L4S NAD 0.0004826 0.42499 3.74532
98 3L4S 3PG 0.0005736 0.42499 3.74532
99 2PV7 NAD 0.0002767 0.42111 3.74532
100 3WLE NAD 0.001006 0.41991 3.74532
101 4MP8 NAD 0.001259 0.41751 3.74532
102 1SC6 NAD 0.0008056 0.41671 3.74532
103 1HYE NAP 0.000191 0.41019 3.74532
104 2B5W NAP 0.0009405 0.40915 3.74532
105 4PLG OXM 0.01533 0.40364 3.74532
106 4E5N NAD 0.001881 0.40155 3.74532
107 4DSG FAD 0.01025 0.40095 3.74532
108 4DSG UDP 0.01025 0.40095 3.74532
109 2DT5 NAD 0.0003446 0.42073 3.79147
110 1WVG APR 0.0000003063 0.51106 4.11985
111 1SOW NAD 0.0001151 0.44746 4.11985
112 2QZZ NAP 0.0003093 0.44008 4.11985
113 2QZZ EMF 0.0003341 0.44008 4.11985
114 2FZW NAD 0.0007495 0.43255 4.11985
115 2IXB A2G 0.001459 0.41628 4.11985
116 2WPF FAD 0.01003 0.41609 4.11985
117 2WPF WPF 0.01029 0.41609 4.11985
118 2IXB NAD 0.00089 0.41277 4.11985
119 3HAD NAD 0.003682 0.41085 4.11985
120 3OFK SAH 0.01084 0.41402 4.16667
121 1PNO NAP 0.00166 0.40411 4.44444
122 2VDV SAM 0.003176 0.44711 4.47154
123 4OOE NDP 0.000667 0.45711 4.49438
124 4OOE FOM 0.000667 0.45711 4.49438
125 3CIF NAD 0.0001183 0.43821 4.49438
126 3V1Y NAD 0.00009623 0.43473 4.49438
127 2B4R NAD 0.0002843 0.43074 4.49438
128 1DLJ NAI 0.001484 0.42693 4.49438
129 1DLJ UGA 0.001568 0.42602 4.49438
130 3CIF G3H 0.001053 0.41795 4.49438
131 4ZGS NAD 0.0002027 0.41538 4.49438
132 2B4R AES 0.0006778 0.41448 4.49438
133 4PLT NAI 0.0002465 0.46165 4.53172
134 4PLT OXM 0.0002939 0.45688 4.53172
135 2G5C NAD 0.0003951 0.42239 4.62633
136 5IN4 6CK 0.000007104 0.57342 4.67033
137 5IN4 NAP 0.000007261 0.57342 4.67033
138 5IN4 GDP 0.000007734 0.57093 4.67033
139 1LLU NAD 0.0008893 0.41938 4.67836
140 3BAZ NAP 0.0002213 0.46302 4.8048
141 1ORR NAD 0.000000006374 0.60517 4.86891
142 1I2B NAD 0.0000003037 0.57432 4.86891
143 1I2B UPG 0.00108 0.46674 4.86891
144 1I2B USQ 0.00108 0.46674 4.86891
145 1VKO NAD 0.0004007 0.4278 4.86891
146 1C1X NAD 0.0002198 0.41997 4.86891
147 4L8V NAP 0.000451 0.41905 4.86891
148 3C1O NAP 0.0001804 0.41901 4.86891
149 3FPF MTA 0.001535 0.41658 4.86891
150 3FPF TNA 0.001535 0.41658 4.86891
151 1BXG NAD 0.0003928 0.41228 4.86891
152 3HDY GDU 0.009727 0.40252 4.86891
153 3HDY FAD 0.01011 0.40185 4.86891
154 3HDY FDA 0.01079 0.40073 4.86891
155 1BW9 NAD 0.0003013 0.40015 4.86891
156 4YSX FAD 0.002276 0.41124 5.12821
157 1J5P NAD 0.0007734 0.40672 5.13834
158 3WMX NAD 0.0000004132 0.51469 5.24345
159 3ABI NAD 0.00003145 0.46186 5.24345
160 3GGO NAI 0.0001789 0.45381 5.24345
161 3GGO ENO 0.0001789 0.45381 5.24345
162 1LTH NAD 0.00001535 0.44955 5.24345
163 1Q0H NDP 0.001102 0.4301 5.24345
164 1Q0H FOM 0.00166 0.42141 5.24345
165 2ZJ1 NAD 0.002238 0.4209 5.24345
166 2ZJ1 ARJ 0.002631 0.41817 5.24345
167 4RPL 3UC 0.005477 0.4157 5.24345
168 1NYT NAP 0.000325 0.41489 5.24345
169 4RPL FAD 0.005823 0.41271 5.24345
170 4JDR FAD 0.00267 0.40967 5.24345
171 4MOP 2H5 0.005769 0.40574 5.24345
172 3TWO NDP 0.002392 0.40487 5.24345
173 4X9M FAD 0.003404 0.40469 5.24345
174 5CAE SIN 0.002267 0.40327 5.24345
175 4D3F NAP 0.0003089 0.40268 5.24345
176 5CAE COA 0.0005226 0.40075 5.24345
177 2CUL FAD 0.00192 0.40837 5.60345
178 3KO8 NAD 0.000000004299 0.60597 5.61798
179 4ZRN NAD 0.000000009628 0.6008 5.61798
180 4ZRN UPG 0.0000001124 0.58459 5.61798
181 2C29 NAP 0.000001771 0.53197 5.61798
182 2C29 DQH 0.000004207 0.51775 5.61798
183 1Y1P NMN AMP PO4 0.0000001732 0.50725 5.61798
184 1RM0 NAI 0.000417 0.44429 5.61798
185 1RM0 D6P 0.0005364 0.44306 5.61798
186 1HYH NAD 0.0003129 0.42871 5.61798
187 2HK9 NAP 0.0002383 0.42189 5.61798
188 1SAY PYR 0.0007883 0.42129 5.61798
189 1X7D NAD 0.0005483 0.41423 5.61798
190 1X7D ORN 0.00194 0.41056 5.61798
191 5U5G NAP 0.0009097 0.40775 5.61798
192 4J36 1HR 0.004406 0.4034 5.61798
193 4J36 FAD 0.002573 0.40127 5.61798
194 1R37 NAD 0.001049 0.41676 5.76369
195 2PWY SAH 0.0002846 0.40722 5.81395
196 4GLL NAD 0.00000002373 0.57918 5.99251
197 1WDK NAD 0.0003223 0.40502 5.99251
198 5MSO NAP 0.00000002668 0.55356 6.36704
199 1H9A NAP 0.0003186 0.43567 6.36704
200 4MO2 FDA 0.003269 0.40216 6.36704
201 4MO2 FAD 0.003762 0.40098 6.36704
202 5JAQ NAI 0.000002568 0.52016 6.74157
203 1A5Z NAD 0.00003777 0.43016 6.74157
204 4RQU NAD 0.0002086 0.42923 6.74157
205 3B1J NAD 0.0002673 0.42885 6.74157
206 3WQQ NDP 0.00106 0.42476 6.74157
207 3WQQ IB3 0.00106 0.42476 6.74157
208 1ZK7 FAD 0.003629 0.40845 6.74157
209 3B20 NAD 0.0004125 0.40735 6.74157
210 2ZXI FAD 0.002851 0.40436 6.74157
211 3JV7 NAD 0.0008027 0.4122 6.95652
212 2C5A NAD 0.0000001665 0.58326 7.11611
213 2C5A GDC 0.0000001665 0.58326 7.11611
214 2Q1W NAD 0.0000004194 0.53513 7.11611
215 2Q1S NAI 0.000002376 0.52715 7.11611
216 1D1T NAD 0.0002723 0.43372 7.11611
217 2PT9 2MH 0.002025 0.40632 7.11611
218 2E5V FAD 0.004147 0.4044 7.11611
219 2I7C AAT 0.002153 0.40409 7.11611
220 2CDU FAD 0.00277 0.40369 7.11611
221 4YCA NDP 0.001076 0.40123 7.11611
222 2V3B FAD 0.001452 0.41522 7.27273
223 3LU1 NAD 0.00000001053 0.58105 7.41758
224 1HDR NAD 0.00006204 0.4791 7.49064
225 1MV8 NAD 0.0001588 0.42606 7.49064
226 4XB2 HSE 0.0006926 0.41917 7.49064
227 4XB2 NDP 0.0001216 0.41917 7.49064
228 1MUU NAD 0.0004639 0.4071 7.49064
229 1E5Q NDP 0.00001416 0.46852 7.55556
230 5UAV NDP 0.00007762 0.46093 7.86517
231 5UAV TFB 0.00007762 0.46093 7.86517
232 1YQZ FAD 0.008548 0.40341 7.86517
233 4PVD NDP 0.0000002049 0.52336 8.2397
234 1EQ2 NAP 0.0000006903 0.5172 8.2397
235 1UWK NAD 0.0003457 0.44739 8.2397
236 1UWK URO 0.0003457 0.44739 8.2397
237 3A06 FOM 0.0006594 0.42668 8.2397
238 3A06 NDP 0.0006057 0.42547 8.2397
239 2DBZ NAP 0.0004314 0.41847 8.2397
240 2Y6Q FAD 0.001631 0.4059 8.2397
241 2Y6Q I7T 0.004593 0.40543 8.2397
242 5KOK S9T 0.002634 0.40214 8.2397
243 4PIV NDP 0.0000000875 0.55512 8.48485
244 1PZG A3D 0.0002122 0.44614 8.61423
245 3O9Z NAD 0.001305 0.4254 8.61423
246 3O9Z AKG 0.002156 0.41614 8.61423
247 3WGT FAD 0.005616 0.40294 8.61423
248 3WGT QSC 0.006835 0.40048 8.61423
249 2EV9 SKM 0.0007965 0.41715 8.74525
250 2EV9 NAP 0.0007965 0.41715 8.74525
251 4U7W NDP 0.000000005952 0.58117 8.98876
252 1VL0 NAI 0.0000000679 0.53505 8.98876
253 2X6T NAP 0.0000002429 0.53346 8.98876
254 4ZVV NAD 0.0001299 0.4752 8.98876
255 4ZVV GN0 0.0001299 0.4752 8.98876
256 1LDM NAD 0.0001266 0.43929 8.98876
257 1H2B NAJ 0.0003011 0.43518 8.98876
258 4W6Z 8ID 0.001004 0.41995 8.98876
259 2HMT NAI 0.0001539 0.41296 8.98876
260 5BR7 FAD 0.005665 0.41186 8.98876
261 5BR7 FLC 0.0057 0.41175 8.98876
262 4YUW 4JU 0.02579 0.40173 9.3633
263 1J0X NAD 0.001077 0.42659 9.73783
264 3T31 DCQ 0.002811 0.42102 9.73783
265 3T31 FAD 0.002568 0.42101 9.73783
266 4K28 NAD 0.0002268 0.41711 9.73783
267 4KP7 NAP 0.00272 0.41504 9.73783
268 4KP7 1UQ 0.002484 0.41284 9.73783
269 2BKA NDP 0.000002078 0.49778 10.1124
270 5JE8 NAD 0.0003688 0.45397 10.4869
271 2JL1 NAP 0.00004362 0.4302 10.4869
272 2DFV NAD 0.0005592 0.41091 10.4869
273 9LDT NAD 0.00003464 0.46237 11.6105
274 9LDB NAD 0.00004026 0.46025 11.6105
275 1DSS NAD 0.0001821 0.4222 11.6105
276 1YB5 NAP 0.001887 0.40743 11.6105
277 5KKA 6V0 0.00009133 0.4508 11.985
278 1E6E FAD 0.002111 0.40804 12.5
279 5M67 ADE 0.004819 0.40634 12.7341
280 5M67 3D1 0.004992 0.40575 12.7341
281 5M67 NAD 0.005237 0.40495 12.7341
282 3QV1 NAD 0.0001334 0.4257 13.0564
283 4R1S NAP 0.00000004697 0.54384 13.1086
284 1RYD NDP 0.002956 0.40378 13.1086
285 1H6C NDP 0.00372 0.40008 13.1086
286 1E3I CXF 0.0006298 0.41277 13.4831
287 2DC1 NAD 0.0002294 0.42334 13.5593
288 3GFB NAD 0.0007878 0.40507 14.2322
289 1R6D NAD 0.0000003533 0.57054 14.5401
290 1R6D DAU 0.0000008388 0.55473 14.5401
291 3SSO SAH 0.00414 0.4015 14.6067
292 1P0F NAP 0.001553 0.40668 14.7453
293 1U3U NAD 0.001146 0.42453 14.9813
294 1U3U BNF 0.001146 0.42453 14.9813
295 1KOL NAD 0.001601 0.41247 14.9813
296 5L4L NAP 0.000001625 0.48567 15.4605
297 5L4L 7OX 0.0000972 0.45869 15.4605
298 5DN9 NAD 0.001501 0.40979 15.7303
299 2CDC XYP 0.0091 0.40559 15.7303
300 2CDC XYS 0.01025 0.40352 15.7303
301 2CDC NAP 0.01025 0.40352 15.7303
302 5LD5 NAD 0.0001314 0.41873 16.1049
303 1RM4 NDP 0.0006611 0.40816 16.6172
304 4EUE NAI 0.00000002061 0.58231 16.8539
305 1OC2 TDX 0.0000004236 0.56986 16.8539
306 1OC2 NAD 0.0000004236 0.56986 16.8539
307 3UOY FAD 0.007422 0.40977 16.8539
308 3UOY NAP 0.007422 0.40977 16.8539
309 1UDB NAD 0.0000001041 0.58859 17.2285
310 1UDB UFG 0.001218 0.46196 17.2285
311 1EK6 NAI 0.0000001673 0.58318 18.3521
312 1EK6 UPG 0.000000524 0.56624 18.3521
313 1I0Z NAI 0.0000719 0.44761 18.3521
314 1CF2 NAP 0.0008296 0.40344 18.3521
315 4HXY NDP 0.00000000001965 0.68362 18.7266
316 3A4V PYR 0.00000000659 0.61097 19.4757
317 3A4V NAD 0.00000000659 0.61097 19.4757
318 1Z45 NAD 0.000000005833 0.59016 20.9738
319 3RFV NAI 0.00000004597 0.55006 21.3483
320 3RFV 15L 0.000002034 0.48886 21.3483
321 3MJE NDP 0.00000000002032 0.67588 21.7228
322 2GN4 NDP 0.00000001483 0.66427 25.8427
323 2GN4 UD1 0.00000004942 0.6445 25.8427
324 3ORF NAD 0.0000007021 0.51481 27.0916
325 2FR1 NDP 0.0000000001467 0.65859 27.7154
326 1XSE NDP 0.00000000004525 0.69965 28.839
327 4K26 NDP 0.0000000001215 0.65586 29.9625
328 4K26 SFF 0.0000000007193 0.65269 29.9625
329 1BXK NAD 0.00000002283 0.56537 30.3371
330 1KEW TYD 0.0000007888 0.5533 30.3371
331 1KEW NAD 0.000001191 0.54762 30.3371
332 3RJ5 NAD 0.00000000001801 0.71016 30.7087
333 4J7U YTZ 0.0000000001511 0.68406 30.7116
334 4J7U NAP 0.0000000001511 0.68406 30.7116
335 3CH6 311 0.0000000009454 0.68055 30.7116
336 3CH6 NAP 0.0000000009454 0.68055 30.7116
337 1SNY NAP 0.000000002682 0.58731 31.4607
338 2PK3 A2R 0.000000362 0.48078 31.8352
339 4J1Q NDP 0.000000004117 0.58478 32.2097
340 1LSS NAD 0.00006671 0.41865 32.8571
341 4TQG NDP 0.0000000002606 0.63235 33.3333
342 1FK8 NAD 0.00000000007035 0.63095 33.8521
343 1OAA OAA 0.00000000003999 0.70785 34.3629
344 5GT9 NAP 0.0000000003911 0.63895 34.6008
345 3TN7 NJP 0.000000000003292 0.71182 34.6304
346 1A27 NAP 0.000000001709 0.61104 35.206
347 3HB5 NAP 0.0000000004647 0.54585 35.206
348 4YAG NAI 0.00000000002517 0.71342 35.5805
349 1Z6Z NAP 0.00000000004162 0.66632 35.8156
350 1V35 NAI 0.000000122 0.57281 36.7041
351 3WXB NDP 0.000000000006788 0.70028 37.4532
352 1N5D NDP 0.00000000001498 0.68776 38.9513
353 1WMA AB3 0.00000000003102 0.71202 39.3258
354 1WMA NDP 0.00000000003102 0.71202 39.3258
355 3O26 NDP 0.0000000000005653 0.73054 40.824
356 2JAP NDP 0.0000000000009931 0.72917 41.2955
357 2DKN NAI 0.0000000000002837 0.73274 41.5686
358 5L4S NAP 0.00000000000576 0.72616 41.9476
359 5L4S 6KX 0.00000000000576 0.72616 41.9476
360 4OHU 2TK 0.00000003105 0.61427 42.3221
361 4OHU NAD 0.00000003105 0.61427 42.3221
362 3V1U NAD 0.000000000006071 0.66225 42.6966
363 4D42 W0I 0.000000003555 0.64384 42.6966
364 4D42 NAP 0.000000003555 0.64384 42.6966
365 2PD4 DCN 0.00000003068 0.58441 42.6966
366 2PD4 NAD 0.00000003355 0.58298 42.6966
367 3ZV6 NAD 0.0000000001134 0.68676 43.0712
368 3ZV6 4HB 0.0000000001281 0.68676 43.0712
369 1ZBQ NAD 0.00000000003542 0.68093 43.4457
370 1BDB NAD 0.0000000001307 0.66656 43.4457
371 5CG1 NAD BBN 0.0000003577 0.57837 43.4457
372 1GZ6 NAI 0.0000000001552 0.67711 43.8202
373 3U4C NDP 0.0000000005319 0.62095 43.8202
374 2BD0 NAP 0.0000000000001988 0.76189 43.8525
375 3AFN NAP 0.0000000000002558 0.76507 44.186
376 1D7O NAD 0.0000009055 0.53384 44.1948
377 1D7O TCL 0.02356 0.4216 44.1948
378 1QG6 NAD 0.00000001831 0.60713 44.4444
379 1QG6 TCL 0.00000001831 0.60713 44.4444
380 4FC7 COA 0.000000000006986 0.73442 44.5693
381 4FC7 NAP 0.000000000006986 0.73442 44.5693
382 4O1M NAD 0.00000004875 0.56005 44.5693
383 4OSP NAP 0.000000000003077 0.69576 44.8669
384 1MXH DHF 0.00000001244 0.60466 44.9438
385 1MXH NAP 0.00000001756 0.59909 44.9438
386 1NNU TCT 0.007661 0.4437 45
387 1NNU NAD 0.007661 0.4437 45
388 1XG5 NAP 0.00000000009916 0.66009 46.0674
389 3H4V DVP 0.000000004823 0.62733 46.0674
390 3H4V NAP 0.0000000164 0.60558 46.0674
391 3RKR NAP 0.00000002079 0.46615 46.1832
392 3OIG NAD 0.000000007876 0.57592 46.6165
393 5JCJ NAP 0.00000000204 0.64783 46.8165
394 2VZ0 D64 0.00000006008 0.62267 46.8165
395 2VZ0 NAP 0.00000006008 0.62267 46.8165
396 4CM9 NAP 0.0000000007936 0.62148 46.8165
397 5K6A NAP 0.0000000009265 0.61925 46.8165
398 3BMQ NAP 0.000000001023 0.61786 46.8165
399 3JQF NAP 0.00000000109 0.61686 46.8165
400 3JQ8 NAP 0.000000001282 0.61442 46.8165
401 4CME NAP 0.0000000009201 0.61366 46.8165
402 3BMN NAP 0.000000001479 0.61199 46.8165
403 3JQ9 NAP 0.000000002351 0.60553 46.8165
404 4CM8 NAP 0.000000001644 0.60474 46.8165
405 4CM4 NAP 0.000000001747 0.60391 46.8165
406 3BMO NAP 0.000000001805 0.60345 46.8165
407 4CLR NAP 0.000000001941 0.60235 46.8165
408 4CLO NAP 0.000000001307 0.60233 46.8165
409 5JDC NAP 0.000000002154 0.60104 46.8165
410 2WD7 NAP 0.000000002173 0.60072 46.8165
411 4CMI NAP 0.000000002224 0.60043 46.8165
412 5JDI NAP 0.000000002359 0.59975 46.8165
413 3JQ7 NAP 0.000000003073 0.58934 46.8165
414 3JQA NAP 0.00000000522 0.58222 46.8165
415 3JQB NAP 0.000000005979 0.58023 46.8165
416 3JQG NAP 0.000000006066 0.57988 46.8165
417 4ITU NAI 0.000000000000289 0.76314 46.8401
418 4ITU 1HS 0.00000000000121 0.76314 46.8401
419 3OID NDP 0.000000000005682 0.71609 46.8992
420 2JAH NDP 0.000000000001336 0.72461 47.3684
421 4Q9N NAI 0.00000002224 0.57594 47.5655
422 2WYV NAD 0.0000006538 0.52077 47.8927
423 3SJU NDP 0.0000000000008334 0.7317 48.3146
424 1NFQ NAI 0.000000000001949 0.72634 48.4615
425 3GEG NAD 0.00000000004372 0.65013 48.583
426 3OJF IMJ 0.000000005163 0.62444 48.6381
427 3OJF NDP 0.000000004596 0.61467 48.6381
428 5L53 NAP 0.0000000001191 0.59921 48.6891
429 1W8D NAP 0.000000000002446 0.66433 49.0637
430 1W73 NAP 0.000000000003072 0.66157 49.0637
Pocket No.: 2; Query (leader) PDB : 1VL8; Ligand: NAP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 1vl8.bio1) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 1VL8; Ligand: NAP; Similar sites found: 74
This union binding pocket(no: 3) in the query (biounit: 1vl8.bio2) has 34 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1M5B BN1 0.0002413 0.42792 1.14068
2 1K97 CIR 0.001311 0.41952 1.87266
3 1K97 ASP 0.001311 0.41952 1.87266
4 1T26 GBD 0.0000006409 0.53192 2.17391
5 1AL8 FMN 0.0003104 0.41923 2.24719
6 1LGT BP3 0.01064 0.40446 2.24719
7 1ME8 RVP 0.004 0.40309 2.24719
8 2YVF FAD 0.00002759 0.45883 2.62172
9 2YVF NAD 0.00002956 0.45883 2.62172
10 2VJJ RAM GLC GAL NAG NAG GLC 0.0001578 0.42731 2.62172
11 2RL1 UD1 0.0005947 0.41422 2.62172
12 4Q0P 0MK 0.006766 0.40194 2.69231
13 4EA7 COA 0.000128 0.44083 2.72727
14 2NLI LAC 0.001666 0.40442 2.99625
15 2NLI FMN 0.001532 0.40398 2.99625
16 4KCF AKM 0.001329 0.4008 2.99625
17 2YYJ FAD 0.005425 0.40001 2.99625
18 2YYJ 4HP 0.005425 0.40001 2.99625
19 4PNI KQQ 0.0002216 0.43145 3.37079
20 3EAU NDP 0.0008326 0.42454 3.37079
21 3EAU PDN 0.0008326 0.42454 3.37079
22 2GYI HYA 0.002319 0.40296 3.37079
23 4JTA NAP 0.003414 0.40172 3.37079
24 1XOC VAL ASP SER LYS ASN THR SER SER TRP 0.0006039 0.40162 3.37079
25 1UXG FUM 0.00000003837 0.51574 3.55987
26 1PEA ACM 0.004163 0.46217 3.74532
27 4MP8 MLI 0.00001124 0.44585 3.74532
28 4DEM YS4 0.001724 0.41576 3.74532
29 3F3E LEU 0.0002705 0.40774 3.74532
30 4N02 FNR 0.001506 0.40094 3.74532
31 4CMF PXG 0.001383 0.4003 3.74532
32 1RYI GOA 0.0004332 0.40899 4.11985
33 1RYI FAD 0.0004366 0.4089 4.11985
34 4TMK T5A 0.00022 0.40265 4.22535
35 2WUF KEM 0.0000176 0.41014 4.49438
36 4R33 TRP 0.0002667 0.40394 4.49438
37 4R33 SAH 0.0002667 0.40394 4.49438
38 1P4C FMN 0.002457 0.40355 4.49438
39 1KY8 NAP 0.002276 0.41624 5.24345
40 1QF5 GDP 0.0006481 0.40802 5.24345
41 1QF5 RPL 0.0006481 0.40802 5.24345
42 1GSA ADP 0.001064 0.40179 5.24345
43 1G8S MET 0.001988 0.46363 5.61798
44 4I4Z 2NE 0.00001096 0.4325 5.61798
45 4G87 UD1 0.0005121 0.4095 5.61798
46 3JYN NDP 0.0002994 0.40118 5.61798
47 4BJZ P3A 0.0009471 0.41896 5.99251
48 4BJZ FAD 0.0009471 0.41896 5.99251
49 1C0I FAD 0.0003766 0.41283 5.99251
50 1C0I BE2 0.0003766 0.41283 5.99251
51 1IIM TTP 0.000256 0.4084 5.99251
52 2YPO PHE 0.0001648 0.40192 5.99251
53 2BJK NAD 0.00006322 0.44192 7.11611
54 2BLE 5GP 0.001146 0.4093 7.11611
55 4ORR PE3 0.0003422 0.42176 7.36842
56 1FIQ FAD 0.0002032 0.40714 7.49064
57 1GS5 NLG 0.0003083 0.40084 7.75194
58 1GS5 ANP 0.0003083 0.40084 7.75194
59 3IAE D7K 0.0001037 0.4094 8.2397
60 1YBH FAD 0.0004488 0.40408 8.61423
61 1V7R CIT 0.01386 0.4501 9.13978
62 3ULK NDP 0.00000588 0.42075 9.3633
63 1TV5 FMN 0.0007187 0.40061 9.73783
64 3HAZ NAD 0.00005944 0.41341 10.4869
65 4NAT ADP 0.000921 0.42436 10.625
66 4NAT 2W5 0.0001246 0.41703 10.625
67 4OYA 1VE 0.003834 0.41182 10.8511
68 3FPZ AHZ 0.001462 0.41685 12.7341
69 3WSJ MK1 0.0005799 0.40942 14.6552
70 3S9K CIT 0.0002955 0.5712 15.2542
71 1E8G FCR 0.002293 0.41614 15.3558
72 1E8G FAD 0.002464 0.41614 15.3558
73 5A2J ALA PRO ASP THR ARG PRO 0.03908 0.41542 15.5738
74 3OND ADN 0.000005913 0.46705 17.2285
Pocket No.: 4; Query (leader) PDB : 1VL8; Ligand: NAP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 1vl8.bio2) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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